TeachOpenCADD_Workflow1_Data_acquisition_ChEMBL
TeachOpenCADD Workflow 1: Data acquisition from ChEMBL
Information on compound structure, bioactivity, and associated targets are organized in databases such as ChEMBL, PubChem, or DrugBank.
This workflow shows how to obtain and preprocess data for a query target (default target: EGFR) from the ChEMBL web services.
Nodes
Extensions
- FeatureKNIME Base nodes
- FeatureKNIME JavaScript Views
- FeatureKNIME Javasnippet
- FeatureKNIME JSON-Processing
- FeatureKNIME Math Expression (JEP)
- Show all 7 modules
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